Detailed information for compound 1269546

Basic information

Technical information
  • TDR Targets ID: 1269546
  • Name: 2-[(3-chloro-4-ethoxyphenyl)methylsulfanyl]-4 ,5-dihydro-1H-imidazole; hydron; chloride
  • MW: 307.239 | Formula: C12H16Cl2N2OS
  • H donors: 1 H acceptors: 0 LogP: 3.43 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1ccc(cc1Cl)CSC1=NCCN1.Cl
  • InChi: 1S/C12H15ClN2OS.ClH/c1-2-16-11-4-3-9(7-10(11)13)8-17-12-14-5-6-15-12;/h3-4,7H,2,5-6,8H2,1H3,(H,14,15);1H
  • InChiKey: XQOZZCVCSUQXOU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[(3-chloro-4-ethoxyphenyl)methylsulfanyl]-4,5-dihydro-1H-imidazole hydrochloride
  • 2-[(3-chloro-4-ethoxy-phenyl)methylsulfanyl]-4,5-dihydro-1H-imidazole; hydron; chloride
  • 2-[(3-chloro-4-ethoxy-phenyl)methylsulfanyl]-4,5-dihydro-1H-imidazole hydrochloride
  • 2-[(3-chloro-4-ethoxyphenyl)methylthio]-4,5-dihydro-1H-imidazole; hydron; chloride
  • 2-[(3-chloro-4-ethoxyphenyl)methylthio]-4,5-dihydro-1H-imidazole hydrochloride
  • 2-[(3-chloro-4-ethoxy-benzyl)thio]-4,5-dihydro-1H-imidazole; hydron; chloride
  • 2-[(3-chloro-4-ethoxy-benzyl)thio]-4,5-dihydro-1H-imidazole hydrochloride
  • 2-(3-Chloro-4-ethoxy-benzylsulfanyl)-4,5-dihydro-1H-imidazole
  • MLS000070677
  • SMR000001199

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ubiquitin specific peptidase 2 Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania infantum ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma congolense ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis ubiquitin specific protease 41 Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania mexicana ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum IPR001394,Peptidase C19, ubiquitin carboxyl-terminal hydrolase 2,domain-containing Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 Get druggable targets OG5_127431 All targets in OG5_127431
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Cryptosporidium parvum ubiquitin C-terminal hydrolase of the cysteine proteinase fold Get druggable targets OG5_127431 All targets in OG5_127431
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 Get druggable targets OG5_127431 All targets in OG5_127431
Cryptosporidium hominis ubiquitin specific protease 66 Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum IPR015063,Domain of unknown function DUF1873,domain-containing Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma brucei gambiense ubiquitin carboxyl-terminal hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) Get druggable targets OG5_127431 All targets in OG5_127431
Candida albicans ubiquitin-specific protease Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum expressed protein Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum Ubiquitin carboxyl-terminal hydrolase 8, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania donovani ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus ubiquitin specific protease 41 Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum ko:K01072 ubiquitin thiolesterase [EC3.1.2.15], putative Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania braziliensis ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum Ubiquitin carboxyl-terminal hydrolase 8, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum ubiquitin specific protease, putative ubiquitin specific peptidase 2 362 aa 378 aa 25.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Schistosoma mansoni neurotransmitter gated ion channel 0.0088 0.297 0.297
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.0191 1 1
Schistosoma mansoni neurotransmitter gated ion channel 0.0088 0.297 0.297
Brugia malayi Animal haem peroxidase family protein 0.0117 0.4938 0.4938
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.0191 1 1
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0191 1 1
Loa Loa (eye worm) GABA receptor subunit 0.0103 0.3981 0.3981
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.0191 1 1
Onchocerca volvulus Peroxidase homolog 0.0117 0.4938 0.2799
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0191 1 1
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0191 1 1
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0191 1 1
Loa Loa (eye worm) blistered cuticle protein 3 0.0117 0.4938 0.4938
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0103 0.3981 0.3981
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0045 0 0.5
Entamoeba histolytica hypothetical protein 0.0103 0.3981 1
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Brugia malayi Animal haem peroxidase family protein 0.0117 0.4938 0.4938
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Echinococcus granulosus glycine receptor subunit alpha 1 0.0191 1 1
Schistosoma mansoni nAChR subunit 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.0191 1 1
Echinococcus multilocularis glycine receptor subunit beta 0.0191 1 1
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0103 0.3981 0.3981
Brugia malayi hypothetical protein 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0103 0.3981 0.3981
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0088 0.297 0.297
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0191 1 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0191 1 1
Loa Loa (eye worm) ACC-1 protein 0.0191 1 1
Onchocerca volvulus 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0191 1 1
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0 0.5
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.0191 1 1
Schistosoma mansoni nAChR subunit 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Echinococcus multilocularis nAChR subunit 0.0103 0.3981 0.3981
Brugia malayi Acetylcholine receptor protein, alpha-like chain 1 precursor 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0103 0.3981 0.3981
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0191 1 1
Schistosoma mansoni acetylcholine receptor-related 0.0088 0.297 0.297
Schistosoma mansoni peroxidasin 0.0117 0.4938 0.4938
Loa Loa (eye worm) animal heme peroxidase 0.0117 0.4938 0.4938
Echinococcus granulosus nAChR subunit 0.0103 0.3981 0.3981
Echinococcus granulosus gamma aminobutyric acid receptor subunit 0.0088 0.297 0.297
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0088 0.297 0.297
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Brugia malayi hypothetical protein 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0103 0.3981 0.3981
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.0191 1 1
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0191 1 1
Brugia malayi Animal haem peroxidase family protein 0.0117 0.4938 0.4938
Loa Loa (eye worm) animal heme peroxidase 0.0117 0.4938 0.4938
Onchocerca volvulus 0.0191 1 1
Echinococcus granulosus nAChR subunit 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0191 1 1
Echinococcus multilocularis glycine receptor subunit beta 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Echinococcus granulosus glycine receptor subunit alpha 1 0.0191 1 1
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.0191 1 1
Echinococcus multilocularis gamma aminobutyric acid receptor subunit 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Echinococcus granulosus glycine receptor subunit beta 0.0191 1 1
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.0191 1 1
Brugia malayi hypothetical protein 0.0088 0.297 0.297
Schistosoma mansoni nicotinic acetylcholine receptor alpha 0.0103 0.3981 0.3981
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Schistosoma mansoni nAChR subunit 0.0191 1 1
Onchocerca volvulus 0.0191 1 1
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0191 1 1
Schistosoma mansoni nAChR subunit 0.0088 0.297 0.297
Loa Loa (eye worm) animal heme peroxidase 0.0117 0.4938 0.4938
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0088 0.297 0.297
Onchocerca volvulus Chorion peroxidase homolog 0.0117 0.4938 0.2799
Schistosoma mansoni peroxidasin 0.0117 0.4938 0.4938
Onchocerca volvulus Putative nachr subunit 0.0191 1 1
Onchocerca volvulus Peroxidase homolog 0.0117 0.4938 0.2799
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0103 0.3981 0.3981
Onchocerca volvulus Dual oxidase homolog 0.0117 0.4938 0.2799
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Onchocerca volvulus 0.0191 1 1
Schistosoma mansoni nAChR subunit 0.0191 1 1
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Brugia malayi Neuronal acetylcholine receptor protein, alpha-2 chain precursor 0.0088 0.297 0.297
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.0191 1 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0045 0 0.5
Loa Loa (eye worm) neuronal acetylcholine receptor protein 0.0088 0.297 0.297
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0191 1 1
Brugia malayi Animal haem peroxidase family protein 0.0117 0.4938 0.4938
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0103 0.3981 0.3981
Brugia malayi hypothetical protein 0.0088 0.297 0.297
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0191 1 1
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0103 0.3981 0.3981
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0103 0.3981 0.3981
Brugia malayi Cation transporter family protein 0.0191 1 1
Onchocerca volvulus Peroxidasin homolog 0.0117 0.4938 0.2799
Onchocerca volvulus 0.0117 0.4938 0.2799
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.0191 1 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0088 0.297 0.297
Loa Loa (eye worm) animal heme peroxidase 0.0117 0.4938 0.4938
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0103 0.3981 0.3981
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0191 1 1
Echinococcus multilocularis nicotinic acetylcholine receptor subunit type 0.0088 0.297 0.297
Brugia malayi Cation transporter family protein 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0191 1 1
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.0191 1 1
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0088 0.297 0.297
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Onchocerca volvulus 0.0191 1 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0191 1 1
Schistosoma mansoni nAChR subunit 0.0191 1 1
Brugia malayi Blistered cuticle protein 3 0.0117 0.4938 0.4938
Brugia malayi hypothetical protein 0.0117 0.4938 0.4938
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.0191 1 1
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0103 0.3981 0.3981
Onchocerca volvulus 0.0191 1 1
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0 0.5
Loa Loa (eye worm) ACC-1 protein 0.0191 1 1
Brugia malayi Animal haem peroxidase family protein 0.0117 0.4938 0.4938
Trichomonas vaginalis conserved hypothetical protein 0.0045 0 0.5
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0045 0 0.5
Schistosoma mansoni neurotransmitter gated ion channel 0.0103 0.3981 0.3981
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Brugia malayi hypothetical protein 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0103 0.3981 0.3981
Echinococcus granulosus glycine receptor subunit beta 0.0191 1 1
Onchocerca volvulus 0.0103 0.3981 0.1438
Brugia malayi Peroxidasin 0.0117 0.4938 0.4938
Onchocerca volvulus 0.0103 0.3981 0.1438
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0191 1 1
Loa Loa (eye worm) acetylcholine receptor protein 0.0088 0.297 0.297
Echinococcus granulosus glycine receptor subunit alpha 1 0.0191 1 1
Schistosoma mansoni nAChR subunit 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Echinococcus multilocularis peroxidasin 0.0117 0.4938 0.4938
Loa Loa (eye worm) LGC-31 protein 0.0191 1 1
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0191 1 1
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Brugia malayi Cation transporter family protein 0.0191 1 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0045 0 0.5
Echinococcus granulosus peroxidasin 0.0117 0.4938 0.4938
Loa Loa (eye worm) hypothetical protein 0.0103 0.3981 0.3981
Schistosoma mansoni nAChR subunit 0.0191 1 1
Schistosoma mansoni acetylcholine receptor subunit beta 0.0088 0.297 0.297
Onchocerca volvulus 0.0117 0.4938 0.2799
Onchocerca volvulus Peroxidasin homolog 0.0117 0.4938 0.2799
Onchocerca volvulus 0.0117 0.4938 0.2799
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0191 1 1
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.0103 0.3981 0.3981
Loa Loa (eye worm) hypothetical protein 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Loa Loa (eye worm) hypothetical protein 0.0117 0.4938 0.4938
Schistosoma mansoni nAChR subunit 0.0191 1 1
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.297 0.297
Echinococcus multilocularis nAChR subunit 0.0191 1 1
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0191 1 1
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0191 1 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 7.9433 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Ubiquitin-specific Protease USP2a. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 16.3601 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 18.526 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 20.5962 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 20.5962 uM PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 28.1838 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 29.081 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 31.6228 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS of alpha-syn Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 39.8107 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 39.8107 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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